| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
D |
89 |
23 |
7946 |
◊ |
C |
x,y,z |
1_555 |
83 |
21 |
7811 |
825.8 |
-10.7 |
0.318 |
7 |
0 |
0 |
0.193 |
2 |
|
B |
88 |
22 |
7982 |
◊ |
A |
x,y,z |
1_555 |
86 |
22 |
7775 |
819.2 |
-10.8 |
0.277 |
7 |
0 |
0 |
0.193 |
| Average: |
822.5 |
-10.7 |
0.298 |
7 |
0 |
0 |
0.193 |
| 2 |
3 |
|
B |
83 |
18 |
7982 |
◊ |
C |
x,y,z |
1_555 |
71 |
17 |
7811 |
682.8 |
-5.8 |
0.565 |
6 |
0 |
0 |
0.107 |
4 |
|
D |
85 |
19 |
7946 |
◊ |
A |
x,y,z |
1_555 |
71 |
17 |
7775 |
679.5 |
-5.3 |
0.611 |
7 |
2 |
0 |
0.107 |
| Average: |
681.2 |
-5.6 |
0.588 |
7 |
1 |
0 |
0.107 |
| 3 |
5 |
|
[HEM]A:201 |
43 |
1 |
836 |
f |
A |
x,y,z |
1_555 |
70 |
26 |
7775 |
606.2 |
-20.3 |
0.431 |
2 |
0 |
0 |
0.297 |
6 |
|
[HEM]C:201 |
43 |
1 |
827 |
f |
C |
x,y,z |
1_555 |
71 |
26 |
7811 |
596.3 |
-20.8 |
0.352 |
1 |
0 |
0 |
0.297 |
| Average: |
601.2 |
-20.6 |
0.392 |
2 |
0 |
0 |
0.297 |
| 4 |
7 |
|
[HEM]D:201 |
43 |
1 |
835 |
f |
D |
x,y,z |
1_555 |
61 |
25 |
7946 |
565.4 |
-19.4 |
0.254 |
0 |
0 |
0 |
0.270 |
8 |
|
[HEM]B:201 |
43 |
1 |
833 |
f |
B |
x,y,z |
1_555 |
63 |
23 |
7982 |
562.6 |
-18.7 |
0.288 |
1 |
0 |
0 |
0.270 |
| Average: |
564.0 |
-19.0 |
0.271 |
1 |
0 |
0 |
0.270 |
| 5 |
9 |
|
C |
36 |
11 |
7811 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
7775 |
297.3 |
3.0 |
0.938 |
5 |
4 |
0 |
0.000 |
| 6 |
10 |
|
A |
31 |
10 |
7775 |
◊ |
B |
x,y,z-1 |
1_554 |
34 |
12 |
7982 |
295.4 |
-2.3 |
0.463 |
4 |
0 |
0 |
0.000 |
| 7 |
11 |
|
B |
34 |
11 |
7982 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
8 |
7811 |
278.3 |
-0.8 |
0.690 |
2 |
0 |
0 |
0.000 |
| 8 |
12 |
|
D |
19 |
8 |
7946 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
23 |
8 |
7811 |
195.5 |
-2.5 |
0.432 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
D |
24 |
9 |
7946 |
◊ |
A |
x-1,y,z |
1_455 |
20 |
9 |
7775 |
190.0 |
0.0 |
0.711 |
1 |
1 |
0 |
0.000 |
| 10 |
14 |
|
D |
23 |
6 |
7946 |
◊ |
C |
x,y,z-1 |
1_554 |
21 |
8 |
7811 |
179.9 |
-1.3 |
0.592 |
2 |
0 |
0 |
0.000 |
| 11 |
15 |
|
D |
22 |
8 |
7946 |
◊ |
B |
x-1,y,z |
1_455 |
18 |
6 |
7982 |
163.4 |
0.6 |
0.782 |
3 |
0 |
0 |
0.000 |
| 12 |
16 |
|
D |
14 |
5 |
7946 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
19 |
7 |
7811 |
140.6 |
-3.4 |
0.246 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[SO4]B:147 |
5 |
1 |
193 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
7982 |
113.2 |
-15.8 |
0.815 |
4 |
0 |
0 |
0.245 |
| 14 |
18 |
|
[SO4]D:147 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
18 |
7 |
7946 |
101.9 |
-15.5 |
0.796 |
4 |
0 |
0 |
0.241 |
| 15 |
19 |
|
B |
7 |
2 |
7982 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
12 |
5 |
7775 |
94.4 |
-0.7 |
0.558 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
B |
7 |
3 |
7982 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
4 |
7982 |
74.0 |
-1.3 |
0.311 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[HEM]D:201 |
6 |
1 |
835 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
12 |
4 |
7811 |
73.9 |
-3.0 |
0.543 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
A |
11 |
4 |
7775 |
◊ |
C |
x,y,z-1 |
1_554 |
9 |
3 |
7811 |
71.0 |
-1.0 |
0.528 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
D |
12 |
5 |
7946 |
x |
D |
-x,y-1/2,-z |
2_545 |
9 |
5 |
7946 |
69.3 |
-0.4 |
0.567 |
1 |
0 |
0 |
0.000 |
| 20 |
24 |
|
C |
10 |
3 |
7811 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
4 |
7775 |
66.1 |
-0.6 |
0.565 |
1 |
0 |
0 |
0.000 |
| 21 |
25 |
|
B |
6 |
2 |
7982 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
7775 |
63.2 |
-1.4 |
0.346 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
A |
8 |
5 |
7775 |
◊ |
[HEM]B:201 |
x,y,z-1 |
1_554 |
8 |
1 |
833 |
61.6 |
-2.8 |
0.666 |
1 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[HEM]A:201 |
1 |
1 |
836 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
7811 |
11.8 |
-0.8 |
0.233 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[HEM]C:201 |
1 |
1 |
827 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7982 |
2.9 |
0.1 |
0.883 |
0 |
0 |
0 |
0.000 |
29 |
|
[HEM]A:201 |
1 |
1 |
836 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
7946 |
1.5 |
0.0 |
0.860 |
0 |
0 |
0 |
0.000 |
| Average: |
2.2 |
0.1 |
0.871 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
A |
1 |
1 |
7775 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
7775 |
1.0 |
0.0 |
0.656 |
0 |
0 |
0 |
0.000 |
|